6-Quinolinecarboxylicacid,3-chloro-2-(3,4-dimethyl-3-penten-1-yl)-1,2,3,4-tetrahydro-2-(methoxymethyl)-,(2R,3R)-

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Names

[ CAS No. ]:
76417-04-4

[ Name ]:
6-Quinolinecarboxylicacid,3-chloro-2-(3,4-dimethyl-3-penten-1-yl)-1,2,3,4-tetrahydro-2-(methoxymethyl)-,(2R,3R)-

[Synonym ]:
(-)-virantmycin
6-Quinolinecarboxylic acid,3-chloro-2-(3,4-dimethyl-3-pentenyl)-1,2,3,4-tetrahydro-2-(methoxymethyl)
6-Quinolinecarboxylic acid,1,2,3,4-tetrahydro-3-chloro-2-(3,4-dimethyl-3-pentenyl)-2-(methoxymethyl)-,(2S-trans)

Chemical & Physical Properties

[ Molecular Formula ]:
C19H26ClNO3

[ Molecular Weight ]:
351.86800

[ Exact Mass ]:
351.16000

[ PSA ]:
58.56000

[ LogP ]:
4.61990

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
ZA4826100
CHEMICAL NAME :
6-Quinolinecarboxylic acid, 1,2,3,4-tetrahydro-3-chloro-2-(3,4-dimethyl-3-penteny l)- 2-(methoxymethyl)-, (2S-trans)-
CAS REGISTRY NUMBER :
76417-04-4
LAST UPDATED :
199307
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C19-H26-Cl-N-O3
MOLECULAR WEIGHT :
351.91

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
5 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
JANTAJ Journal of Antibiotics. (Japan Antibiotics Research Assoc., 2-20-8 Kamiosaki, Shinagawa-ku, Tokyo, 141, Japan) V.2-5, 1948-52; V.21- 1968- Volume(issue)/page/year: 33,1395,1980

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

  • carbon monoxide
  • (2R,3R)-3-chloro-2-(3,4-dimethylpent-3-enyl)-6-iodo-2-methoxymethyl-1,2,3,4-tetrahydroquinoline
  • tert-butyl (2S)-5-iodo-2-(methoxyacetyl)indoline-1-carboxylate
  • (2R)-2-[(2S)-2,3-dihydro-5-iodo-1H-indol-2-yl]-1-methoxy-5,6-dimethylhept-5-en-2-ol
  • tert-butyl (2S)-2-[(1R)-1-hydroxy-1-methoxymethyl-4,5-dimethylhex-4-enyl]-5-iodoindoline-1-carboxylate
  • (2S)-2-Indolinecarboxylic acid
  • 1H-Indole-2-carboxylicacid,2,3-dihydro-,methylester,(2S)-(9CI)
  • methyl (S)-N-(tert-butoxycarbonyl)indoline-2-carboxylate
  • tert-butyl (2S)-2-{[methoxy(methyl)amino]carbonyl}indoline-1-carboxylate

DownStream

Related Compounds

  • 3-(3-chlorobenzyl)quinazoline-2,4(1H,3H)-dione
  • 3-(4-Chlorobenzoyl)piperidine
  • 3-methyl-2-phenyl-4a,5,6,7,8,8a-hexahydro-3H-quinazolin-4-one
  • 3-(4-methyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)propanoic acid
  • 2-(4-Chlorothiophen-2-yl)acetic acid
  • 3-(Acetylmethylamino)-5-[[2-[(carboxymethyl)thio]acetyl]methylamino]-2,4,6-triiodobenzoic acid
  • N-[2-(3,4-dimethoxyphenyl)ethyl]-4-(4-oxo-3,4-dihydro-1,2,3-benzotriazin-3-yl)benzamide
  • 1-(3-Chloro-4-methylphenyl)-4-(2,4,5-trichlorobenzenesulfonyl)piperazine
  • (Diethyl)(p-methoxyphenyl)phosphine
  • 2,5-Dioxopyrrolidin-1-yl 4-ethoxybenzoate
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